smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H](C(=O)NCC(F)(F)F)N(C)CC(=O)N1CCNCC1 ZINC000159858721 376785957 /nfs/dbraw/zinc/78/59/57/376785957.db2.gz MBJDVOUFANOIMN-SECBINFHSA-N 2 1 310.320 -0.583 20 70 DBIDMP